5,6-dihydro-1H-cyclopenta[d]imidazol-4-one

C6H6N2O — CID 55300269

IUPAC5,6-dihydro-1H-cyclopenta[d]imidazol-4-one
SMILESO=C1CCc2[nH]cnc21
InChIInChI=1S/C6H6N2O/c9-5-2-1-4-6(5)8-3-7-4/h3H,1-2H2,(H,7,8)
InChIKeyNGEJHJXVSLSYSI-UHFFFAOYSA-N
MW122.13 g/mol
LogP0.54
Rot. Bonds

About 5,6-dihydro-1H-cyclopenta[d]imidazol-4-one

5,6-dihydro-1H-cyclopenta[d]imidazol-4-one (PubChem CID 55300269) has the molecular formula C6H6N2O and a molecular weight of 122.13 g/mol. Its IUPAC name is 5,6-dihydro-1H-cyclopenta[d]imidazol-4-one.

Molecular Properties

Compound Name5,6-dihydro-1H-cyclopenta[d]imidazol-4-one
PubChem CID55300269
Molecular FormulaC6H6N2O
Molecular Weight122.13 g/mol
Exact Mass122.05
IUPAC Name5,6-dihydro-1H-cyclopenta[d]imidazol-4-one
SMILESO=C1CCc2[nH]cnc21
InChIInChI=1S/C6H6N2O/c9-5-2-1-4-6(5)8-3-7-4/h3H,1-2H2,(H,7,8)
InChIKeyNGEJHJXVSLSYSI-UHFFFAOYSA-N
XLogP0.54
TPSA45.75 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500122.13
LogP ≤ 50.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 5,6-dihydro-1H-cyclopenta[d]imidazol-4-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 5,6-dihydro-1H-cyclopenta[d]imidazol-4-one?
The IUPAC name of 5,6-dihydro-1H-cyclopenta[d]imidazol-4-one (CID 55300269) is 5,6-dihydro-1H-cyclopenta[d]imidazol-4-one.
What is the SMILES notation for 5,6-dihydro-1H-cyclopenta[d]imidazol-4-one?
The canonical SMILES for 5,6-dihydro-1H-cyclopenta[d]imidazol-4-one is O=C1CCc2[nH]cnc21.
What is the InChIKey of 5,6-dihydro-1H-cyclopenta[d]imidazol-4-one?
The InChIKey is NGEJHJXVSLSYSI-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H6N2O/c9-5-2-1-4-6(5)8-3-7-4/h3H,1-2H2,(H,7,8).
What are the key properties of 5,6-dihydro-1H-cyclopenta[d]imidazol-4-one?
5,6-dihydro-1H-cyclopenta[d]imidazol-4-one has a molecular weight of 122.13 g/mol, XLogP of 0.54, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5,6-dihydro-1H-cyclopenta[d]imidazol-4-one is sourced from PubChem (CID 55300269), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).